SCHEMBL1885192

SCHEMBL1885192

O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
NPC1 O15118 3/20 0.71
MAPT P10636 3/20 0.71
RAB9A P51151 2/20 0.71
POLB P06746 2/20 0.71
GAA P10253 1/20 0.71
EPHX1 P07099 2/20 0.69
EPHX2 P34913 2/20 0.69
LMNA P02545 2/20 0.69
HTT P42858 2/20 0.69
ADORA3 P0DMS8 1/20 0.69
CHRM1 P11229 1/20 0.69
SLC6A2 P23975 1/20 0.69
PDE4A P27815 1/20 0.69
ADRA1A P35348 1/20 0.69
OPRM1 P35372 1/20 0.69
PDE3A Q14432 1/20 0.69
NLRP3 Q96P20 1/20 0.69
P2RY1 P47900 2/20 0.62

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28569820 0.88 MEN1 (0.71) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL1883373 0.87 CA12 (0.71) MEN1KMT2ANPC1POLBEPHX1
SCHEMBL28295632 0.85 KCNMA1 (0.68) MEN1KMT2APOLBNTRK1CDK19
SCHEMBL1875397 0.83 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL1878682 0.83 MEN1 (0.65) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL1882786 0.83 NTRK1 (0.60) MEN1KMT2AMAPTRAB9APOLB
Triclocarban SCHEMBL68658 0.82 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A
Triclocarban SCHEMBL30479188 0.82 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A
Triclocarban SCHEMBL4978963 0.82 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A
Triclocarban SCHEMBL27313500 0.82 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110110958-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2011-05-12 US claimed
WO-2009054878-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2009-04-30 WO claimed
US-20110110958-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2011-05-12 US disclosed
US-20110110958-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2011-05-12 US disclosed
US-20110110958-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2011-05-12 US disclosed
WO-2009054878-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2009-04-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110110958-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEOPLASIA TP53, NUP205, ANXA5 MEN1 2133/4885KMT2A 2664/4885NPC1 173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.